Every medication in your cabinet, every material in your phone's battery, and virtually every compound that makes modern life work started as a molecular guess, with scientists hypothesizing that a ...
Chemists at UCLA are showing that some of organic chemistry’s most famous “rules” aren’t as unbreakable as once thought. By ...
Neo-1 is the first model to unify de novo molecular generation and atomic-level structure prediction in a single model, by generating latent representations of whole molecules instead of predicting ...
This booklet describes the many design principles of green chemistry and engineering in a visually compelling format. Introduction to “Design Principles for Sustainable and Green Chemistry and ...
Molecular assembly is a fundamental concept in nanotechnology that involves the controlled arrangement of molecules or molecular components into ordered structures with desired properties and ...
This review paper published in AI & Materials explores the implementation of first-principles calculation method within high-entropy carbides ceramics (HECCs) research, specifically examining its role ...